ethyl 5-oxidanylidene-2-[(4S)-4-phenyl-1-(phenylmethyl)-4,5-dihydroimidazol-2-yl]hexanoate

Systemtic Name: ethyl 5-oxidanylidene-2-[(4S)-4-phenyl-1-(phenylmethyl)-4,5-dihydroimidazol-2-yl]hexanoate Openeye Name: ethyl 2-[(4S)-1-benzyl-4-phenyl-4,5-dihydroimidazol-2-yl]-5-oxo-hexanoate CAS Name: 5-oxo-2-[(4S)-4-phenyl-1-(phenylmethyl)-4,5-dihydroimidazol-2-yl]hexanoic acid ethyl ester IUPAC Name: ethyl 2-[(4S)-1-benzyl-4-phenyl-4,5-dihydroimidazol-2-yl]-5-oxohexanoate Traditional Name: 2-[(4S)-1-benzyl-4-phenyl-2-imidazolin-2-yl]-5-keto-hexanoic acid ethyl ester Formula: C24H28N2O3 MolecularWeight: 392.49072

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(CCC(=O)C)C1=NC(CN1CC2=CC=CC=C2)C3=CC=CC=C3

Isomeric SMILES

CCOC(=O)C(CCC(=O)C)C1=N[C@H](CN1CC2=CC=CC=C2)C3=CC=CC=C3

InChI

InChI=1S/C24H28N2O3/c1-3-29-24(28)21(15-14-18(2)27)23-25-22(20-12-8-5-9-13-20)17-26(23)16-19-10-6-4-7-11-19/h4-13,21-22H,3,14-17H2,1-2H3/t21?,22-/m1/s1